4-ethyl-2-indazol-1-ylcyclohexan-1-amine

C15H21N3 — CID 62139994

IUPAC4-ethyl-2-indazol-1-ylcyclohexan-1-amine
SMILESCCC1CCC(N)C(n2ncc3ccccc32)C1
InChIInChI=1S/C15H21N3/c1-2-11-7-8-13(16)15(9-11)18-14-6-4-3-5-12(14)10-17-18/h3-6,10-11,13,15H,2,7-9,16H2,1H3
InChIKeyHGISCROLWSZVHV-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.11
Rot. Bonds2

About 4-ethyl-2-indazol-1-ylcyclohexan-1-amine

4-ethyl-2-indazol-1-ylcyclohexan-1-amine (PubChem CID 62139994) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 4-ethyl-2-indazol-1-ylcyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-indazol-1-ylcyclohexan-1-amine
PubChem CID62139994
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name4-ethyl-2-indazol-1-ylcyclohexan-1-amine
SMILESCCC1CCC(N)C(n2ncc3ccccc32)C1
InChIInChI=1S/C15H21N3/c1-2-11-7-8-13(16)15(9-11)18-14-6-4-3-5-12(14)10-17-18/h3-6,10-11,13,15H,2,7-9,16H2,1H3
InChIKeyHGISCROLWSZVHV-UHFFFAOYSA-N
XLogP3.11
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-indazol-1-ylcyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-indazol-1-ylcyclohexan-1-amine (CID 62139994) is 4-ethyl-2-indazol-1-ylcyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-indazol-1-ylcyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-indazol-1-ylcyclohexan-1-amine is CCC1CCC(N)C(n2ncc3ccccc32)C1.
What is the InChIKey of 4-ethyl-2-indazol-1-ylcyclohexan-1-amine?
The InChIKey is HGISCROLWSZVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-2-11-7-8-13(16)15(9-11)18-14-6-4-3-5-12(14)10-17-18/h3-6,10-11,13,15H,2,7-9,16H2,1H3.
What are the key properties of 4-ethyl-2-indazol-1-ylcyclohexan-1-amine?
4-ethyl-2-indazol-1-ylcyclohexan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-indazol-1-ylcyclohexan-1-amine is sourced from PubChem (CID 62139994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).